%chk=000068895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068895

0 1
 S    1.928100       1.812800     -0.1285000    
 N   -2.987900     -8.7499999E-02 -0.2123000    
 N    2.607200     -0.6720000      0.1573000    
 C   -1.602700     -0.2644000      0.2186000    
 C   -1.038400      -1.591500     -0.3379000    
 C  -0.7601000      0.9492000     -0.2387000    
 C   0.4003000      -1.850300      0.1489000    
 C   0.6929000      0.6430000     -9.1100000E-02
 C    1.232500     -0.6189000      6.0199998E-02
 C   -3.553800       1.126900      0.3548000    
 C    3.081900      0.5526000      6.8700001E-02
 H   -1.569800     -0.3305000       1.315800    
 H   -1.046500      -1.559500      -1.436100    
 H   -1.671200      -2.436700     -4.0300000E-02
 H   -1.000400       1.837400      0.3575000    
 H  -0.9603000       1.183100      -1.292700    
 H   0.8493000      -2.656900     -0.4408000    
 H   0.3761000      -2.181100       1.194100    
 H   -3.537900     -0.8890000      9.6900001E-02
 H   -4.633900       1.130800      0.1719000    
 H   -3.162800       2.030900     -0.1215000    
 H   -3.409300       1.186800       1.438700    
 H    4.141400      0.7635000      0.1167000    


%chk=000068895-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000068895

0 1
S 2.079699 1.864786 -0.215700
N -2.987176 -0.034307 -0.200178
N 2.666777 -0.706506 0.185219
C -1.583252 -0.209565 0.228820
C -1.038553 -1.548584 -0.325845
C -0.715132 0.977505 -0.285570
C 0.390468 -1.851309 0.185585
C 0.745635 0.644663 -0.137244
C 1.265551 -0.625271 0.073188
C -3.721215 1.082961 0.424772
C 3.239388 0.473906 0.062276
H -1.488969 -0.234062 1.346664
H -1.045671 -1.494269 -1.431516
H -1.717680 -2.374895 -0.034908
H -0.963313 1.902155 0.268383
H -0.979305 1.155704 -1.347137
H 0.842191 -2.678305 -0.392225
H 0.362004 -2.187118 1.241501
H -3.505175 -0.919461 -0.126842
H -4.782469 1.037104 0.123531
H -3.324666 2.050881 0.069411
H -3.675640 1.088525 1.541604
H 4.311204 0.664162 0.106411


